COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK114620
Chemical Name: N-(1-{5-[(2-{[4-bromo-2-(propan-2-yl)phenyl]amino}-2-oxoethyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}ethyl)benzamide
Smiles: O=C(Nc1ccc(cc1C(C)C)Br)CSc1nnc(n1C)C(NC(=O)c1ccccc1)C

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Molecular Weight: 516.46
Empirical Formula: C23H26BrN5O2S

Physical State: Dry powder
Available Amount: 253 mg

Lipinsky:
logP: 5.358
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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